1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide

C19H17ClF2N2O2 — CID 17223520

IUPAC1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide
SMILESO=C(Nc1cc(F)cc(F)c1)C1CCN(C(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C19H17ClF2N2O2/c20-17-4-2-1-3-16(17)19(26)24-7-5-12(6-8-24)18(25)23-15-10-13(21)9-14(22)11-15/h1-4,9-12H,5-8H2,(H,23,25)
InChIKeyJSQWNEYIQYOPGF-UHFFFAOYSA-N
MW378.81 g/mol
LogP4.11
Rot. Bonds3

About 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide

1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide (PubChem CID 17223520) has the molecular formula C19H17ClF2N2O2 and a molecular weight of 378.81 g/mol. Its IUPAC name is 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide
PubChem CID17223520
Molecular FormulaC19H17ClF2N2O2
Molecular Weight378.81 g/mol
Exact Mass378.09
IUPAC Name1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide
SMILESO=C(Nc1cc(F)cc(F)c1)C1CCN(C(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C19H17ClF2N2O2/c20-17-4-2-1-3-16(17)19(26)24-7-5-12(6-8-24)18(25)23-15-10-13(21)9-14(22)11-15/h1-4,9-12H,5-8H2,(H,23,25)
InChIKeyJSQWNEYIQYOPGF-UHFFFAOYSA-N
XLogP4.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.81
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluorophenyl)-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 802933
1-(2,5-difluorobenzoyl)-N-phenylpiperidine-4-carboxamide
CID 46808218
1-(2-aminobenzoyl)-N-(4-fluorophenyl)piperidine-4-carboxamide
CID 119945231
N-(2-bromophenyl)-1-(2-chlorobenzoyl)piperidine-4-carboxamide
CID 1326323
1-(3,4-dichlorobenzoyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 113008225
1-benzoyl-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 110298375
N-(4-butan-2-ylphenyl)-1-(2-chlorobenzoyl)piperidine-4-carboxamide
CID 17223318
N-(3-chlorophenyl)-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 4612076
1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
CID 1072799
1-(2-chlorobenzoyl)-N-(2-chloro-4-nitrophenyl)piperidine-4-carboxamide
CID 17223292
1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 1072829
1-(2-fluorobenzoyl)-N-(2-fluorophenyl)piperidine-4-carboxamide
CID 17019008

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide (CID 17223520) is 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide is O=C(Nc1cc(F)cc(F)c1)C1CCN(C(=O)c2ccccc2Cl)CC1.
What is the InChIKey of 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide?
The InChIKey is JSQWNEYIQYOPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClF2N2O2/c20-17-4-2-1-3-16(17)19(26)24-7-5-12(6-8-24)18(25)23-15-10-13(21)9-14(22)11-15/h1-4,9-12H,5-8H2,(H,23,25).
What are the key properties of 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide?
1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide has a molecular weight of 378.81 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorobenzoyl)-N-(3,5-difluorophenyl)piperidine-4-carboxamide is sourced from PubChem (CID 17223520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).